Basic information
- CAS
1888327-69-2- Standard SMILES
CCCCCc1ccc(-c2ccc(-c3cc(F)c(C(F)(F)Oc4ccc(OC(F)(F)F)cc4)c(F)c3)c(F)c2)cc1- InChIKey
NPAPUMRBTZNJTN-UHFFFAOYSA-N- Molecular formula
- C31H24F8O2
- Average molar mass
- 580.5 g/mol
- Monoisotopic mass
- 580.1648553
Names & identifiers
- Preferred name
- tFMeOPO-CF2-5tFT
- IUPAC
- 2-[difluoro-[4-(trifluoromethoxy)phenoxy]methyl]-1,3-difluoro-5-[2-fluoro-4-(4-pentylphenyl)phenyl]benzene
Names & synonyms
tFMeOPO-CF2-5tFTDTXSID8013780041888327-69-24-(difluoro(4-(trifluoromethoxy)phenoxy)methyl)-2',3,5-trifluoro-4''-pentyl-1,1':4',1''-terphenyl4-[Difluoro[4-(trifluoromethoxy)phenoxy]methyl]-2a(2),3,5-trifluoro-4a(2)a(2)-pentyl-1,1a(2):4a(2),1a(2)a(2)-terphenyl
Database identifiers
- CAS
1888327-69-2- PubChem CID
- 175685533
- DTXSID
DTXSID801378004
Properties
Computed structural properties
- XLogP
- 11.3
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 10
- Heavy atoms
- 41
- Formal charge
- 0
- Complexity
- 767
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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